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4-methyleneadamantane-2-spiro-7'-bicyclo[4.1.0]hept-3'-ene-2',5'-dione
SpectraBase Compound ID BwwfF2fWV9l
InChI InChI=1S/C17H18O2/c1-8-10-4-9-5-11(7-10)17(12(8)6-9)15-13(18)2-3-14(19)16(15)17/h2-3,9-12,15-16H,1,4-7H2/t9-,10+,11-,12+,15?,16?,17?/m1/s1
InChIKey RSVWRSUOLMHKGF-LGLSTOBZSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IKqTqRafNlm
Name 4-methyleneadamantane-2-spiro-7'-bicyclo[4.1.0]hept-3'-ene-2',5'-dione
Alternate Name(s) 4-methylidenespiro[adamantane-2,7'-bicyclo[4.1.0]heptan]-3'-ene-2',5'-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-8-10-4-9-5-11(7-10)17(12(8)6-9)15-13(18)2-3-14(19)16(15)17/h2-3,9-12,15-16H,1,4-7H2/t9-,10+,11-,12+,15?,16?,17?/m1/s1
InChIKey RSVWRSUOLMHKGF-LGLSTOBZSA-N
Molecular Weight 254.329 g/mol
SMILES C12(C3C(C=CC(C23)=O)=O)[C@@]2(C(=C)[C@@]3(C[C@]1(C[C@@](C3)(C2)[H])[H])[H])[H]
SPLASH splash10-0udl-4090000000-b6fb4e5b1a9142068cb9
Source of Spectrum J-54-548-9
Wiley ID 1258251